Vitas-M small molecule compound
cyclohexyl 4-(2-bromophenyl)-2-methyl-5-oxo-1,4,5,6,7,8-hexahydroquinoline-3-carboxylate
Catalog ID
STK089785
SMILES O=C(C1=C(C)NC2=C(C1c1ccccc1Br)C(=O)CCC2)OC1CCCCC1
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We supply compounds in quantities from 1 mg up to 5 g for research and development purposes only.
We do not supply quantities above 5 g.
Structure and other identifiers
2D representation rendered from the SMILES, with core physicochemical data.Formula C23H26BrNO3 MW 444.37 g/mol Purity >90% as per NMR
InChI
InChI=1S/C23H26BrNO3/c1-14-20(23(27)28-15-8-3-2-4-9-15)21(16-10-5-6-11-17(16)24)22-18(25-14)12-7-13-19(22)26/h5-6,10-11,15,21,25H,2-4,7-9,12-13H2,1H3InChIKey
GMUGSLOUSBOHRG-UHFFFAOYSA-NSynonyms
CC1=C(C(C2=C(N1)CCCC2=O)C3=CC=CC=C3Br)C(=O)OC4CCCCC4
cyclohexyl4(2bromophenyl)2methyl5oxo145678hexahydroquinoline3carboxylate
cyclohexyl4(2bromophenyl)2methyl5oxo4678tetrahydro1Hquinoline3carboxylate
InChI=1SC23H26BrNO3c11420(23(27)28158324915)21(1610561117(16)24)2218(2514)1271319(22)26h561011152125H24791213H21H3
MFCD02633339
O=C(C1=C(C)NC2=C(C1c1ccccc1Br)C(=O)CCC2)OC1CCCCC1
STK089785
ZINC000001213393
ZINC000001213397
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